SCHEMBL26229088

SCHEMBL26229088

CC(C)(C)N[C@@H](COC(C)(C)C)C(=O)NCCCCOCCOCCOCCOCCC(CO)COC(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.32
GLP1R P43220 8/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
CA1 P00915 2/20 0.31
CA2 P00918 2/20 0.31
TLR2 O60603 1/20 0.31
GAA P10253 1/20 0.30
CAPN1 P07384 1/20 0.30
CA12 O43570 1/20 0.30
CA9 Q16790 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL21103703 1.00 TDP1 (0.32) TDP1GLP1RMEN1KMT2ACA1
SCHEMBL26081443 0.93 TDP1 (0.32) TDP1MEN1KMT2ACA1CA2
SCHEMBL18501606 0.90 TDP1 (0.36) TDP1MEN1KMT2ACA1CA2
SCHEMBL25671082 0.90 TDP1 (0.36) TDP1MEN1KMT2ACA1CA2
SCHEMBL21104000 0.82 CAPN1 (0.33) TDP1MEN1KMT2ACA1CA2
SCHEMBL24130897 0.74 TDP1 (0.35) TDP1MEN1KMT2ACA1CA2
SCHEMBL26229075 0.74 KMT2A (0.38) TDP1MEN1KMT2AGAACAPN1
SCHEMBL26229151 0.72 TSHR (0.41) MEN1KMT2A
SCHEMBL25671162 0.72 TDP1 (0.40) TDP1MEN1KMT2AGAA
SCHEMBL25671080 0.72 TDP1 (0.40) TDP1MEN1KMT2AGAA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11753638-B2 Conjugated oligonucleotides UNIVERSITY OF MASSACHUSETTS (US) 2023-09-12 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11753638-B2 Conjugated oligonucleotides DCLRE1B, DCLRE1A, TNNC1 TDP1 400/4885GLP1R 4059/4885MEN1 3721/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.